orbital_charges     :real:2:4,6
  0.690393307016095E+000  0.000000000000000E+000  0.000000000000000E+000
  0.000000000000000E+000  0.174084672858117E+001  0.156214250036222E+001
  0.199999999651483E+001  0.132111365734708E+001  0.173609455932895E+001
  0.179910526196212E+001  0.118882684203759E+001  0.186703799744656E+001
  0.708174966712694E+000  0.000000000000000E+000  0.000000000000000E+000
  0.000000000000000E+000  0.693132091345346E+000  0.000000000000000E+000
  0.000000000000000E+000  0.000000000000000E+000  0.693132091345346E+000
  0.000000000000000E+000  0.000000000000000E+000  0.000000000000000E+000
forces              :real:2:3,6
  0.634157599135099E-003  0.466033408342073E-004 -0.332848677289621E-016
 -0.575388415543457E-003 -0.311468962019001E-003 -0.420268102274430E-016
 -0.532486340579286E-003  0.316174719913215E-003 -0.898346203198966E-016
  0.280835046048464E-003  0.175181146221559E-003  0.754455819539652E-016
  0.964410554695622E-004 -0.113245122474945E-003  0.132063985466280E-003
  0.964410554695205E-004 -0.113245122475028E-003 -0.132063985466196E-003
mermin_energy       :real:0:
 -0.815724456040623E+001
end_coords          :real:2:3,6
 -0.944362216902488E+000 -0.121490483805739E-001  0.000000000000000E+000
 -0.277231684236674E+001 -0.278628758660031E+000  0.000000000000000E+000
  0.263153225621761E+001  0.253125016718170E+000  0.000000000000000E+000
 -0.354685316412762E+001  0.137925997646206E+001  0.000000000000000E+000
  0.328270915517005E+001 -0.614444405186437E+000 -0.147306597453512E+001
  0.328270915517005E+001 -0.614444405186437E+000  0.147306597453512E+001
